methyl 2-(6-acetamido-2-propanoylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(6-acetamido-2-propanoylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-(6-acetamido-2-propanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[6-acetamido-2-(1-oxopropylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(6-acetamido-2-propanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(6-acetamido-2-propionylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C15H17N3O4S MolecularWeight: 335.37818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)NC(=O)C)CC(=O)OC

Isomeric SMILES

CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)NC(=O)C)CC(=O)OC

InChI

InChI=1S/C15H17N3O4S/c1-4-13(20)17-15-18(8-14(21)22-3)11-6-5-10(16-9(2)19)7-12(11)23-15/h5-7H,4,8H2,1-3H3,(H,16,19)